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RU.521 | RU.521 : Allosteric inhibitor of CGAS
RATINGS:
Cellular Use: (2 reviews)

In Model Organisms: (0 reviews)
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
References
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Probe Summary

Targets Biochemical/Biophysical Potency Cellular Potency
CGAS
  • KD, IC50:36.2 nM (KD), 110 nM (IC50)
  • IC50:700 nM
Allosteric
up to 5 uM
up to 1 uM

Selectivity

In Cell Selectivity Assessment
Selectivity Assessment Description:
RU.521 did not show any significant inhibition of reporter activity which is distinct from its ac ...

Potency
Cellular
In Vitro

CGAS

Mode of Action: Allosteric

Structure-Activity-Relationship data available? No

Chemical Information

Molecular Formula C19H12Cl2N4O3
SMILEs Cc1nn(-c2nc3ccc(Cl)c(Cl)c3[nH]2)c(O)c1C1OC(=O)c2ccccc21
InChI InChI=1S/C19H12Cl2N4O3/c1-8-13(16-9-4-2-3-5-10(9)18(27)28-16)17(26)25(24-8)19-22-12-7-6-11(20)14(21)15(12)23-19/h2-7,16,26H,1H3,(H,22,23)
Molecular weight 414.03 Da
AlogP 4.329220000000002
HBond acceptors 7
HBond donors 2
Atoms 40

References

Publications

    Cross References

    canSARChEMBLBindingDB

    Vendors

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    Expert Reviews

    by SERP
    (on 2 Dec 2020 )
    Cellular Use Rating
    ( The reviewer did not leave any comments )
    by SERP
    (on 5 Dec 2020 )
    Cellular Use Rating
    The pursued screening hit possessed an acceptable structure but the remaining hits are questionable, including an electrophile and a PAINS compound. This could indicate that non-developable mechanisms...
    Note: The Chemical Probes Portal only endorses compounds as chemical probes for use as specific and selective modulators of the proposed target if they receive three or more (3-4) stars. Read more about our evaluation criteria